Ligand name: (9cis)-retinoic acid
PDB ligand accession: 9CR
DrugBank: DB00523
PubChem: 449171
ChEMBL: CHEMBL705
InChI Key: SHGAZHPCJJPHSC-ZVCIMWCZSA-N
SMILES: CC1=C(C(CCC1)(C)C)C=CC(=CC=CC(=CC(=O)O)C)C

ClassyFire chemical classification:

List of proteins that are targets for 9CR

# DrugDomain Data UniProt Accession Protein name Drug Action Affinity data
1 P22605_9CR P22605 Retinoic acid receptor n/a Kd(nM) = 7.0
2 P13631_9CR P13631 Retinoic acid receptor agonist Ki(nM) = 1.0
IC50(nM) = 17.0
Kd(nM) = 0.8
EC50(nM) = 4.0
3 P10826_9CR P10826 Retinoic acid receptor agonist Ki(nM) = 0.5
IC50(nM) = 7.0
Kd(nM) = 0.2
EC50(nM) = 0.8
4 P22932_9CR P22932 Retinoic acid receptor n/a
5 Q8T5C6_9CR Q8T5C6 Retinoic acid receptor n/a
6 P48443_9CR P48443 Retinoic acid receptor agonist Ki(nM) = 11.0
IC50(nM) = 4.0
Kd(nM) = 14.0
EC50(nM) = 4.3
7 P10632_9CR P10632 Cytochrome P450 2C8 n/a
8 P28700_9CR P28700 Retinoic acid receptor n/a IC50(nM) = 82.0
Kd(nM) = 32.0
EC50(nM) = 200.0
9 P02766_9CR P02766 Transthyretin (ATTR) (Prealbumin) n/a
10 Q15238_9CR Q15238 Pregnancy-specific beta-1-glycoprotein 5 n/a
11 P10276_9CR P10276 Retinoic acid receptor agonist Ki(nM) = 22.0
IC50(nM) = 7.0
Kd(nM) = 0.3
EC50(nM) = 1.0
12 P06911_9CR P06911 Epididymal-specific lipocalin-5 (Androgen-dependent n/a
13 P19793_9CR P19793 Retinoic acid receptor agonist Ki(nM) = 8.0
IC50(nM) = 29.0
Kd(nM) = 1.5
EC50(nM) = 1.5
14 Q6V0L0_9CR Q6V0L0 Cytochrome P450 26C1 n/a
15 P28702_9CR P28702 Retinoic acid receptor agonist Ki(nM) = 3.8
IC50(nM) = 12.0
Kd(nM) = 11.0
EC50(nM) = 2.6